Hydrocortamate hydrochlorideProduct ingredient for Hydrocortamate
- Name
- Hydrocortamate hydrochloride
- Drug Entry
- Hydrocortamate
Hydrocortamate is a synthetic glucocorticoid used for its anti-inflammatory or immunosuppressive properties to treat inflammation due to corticosteroid-responsive dermatoses. Glucocorticoids are a class of steroid hormones characterised by an ability to bind with the cortisol receptor and trigger a variety of important cardiovascular, metabolic, immunologic and homeostatic effects.
- Accession Number
- DBSALT000686
- Structure
- Synonyms
- Hydrocortamate HCl
- UNII
- 9QM8U7R83W
- CAS Number
- 125-03-1
- Weight
- Average: 512.078
Monoisotopic: 511.270065788 - Chemical Formula
- C27H42ClNO6
- InChI Key
- AKQNAIYKSALPKV-OYHXESGYSA-N
- InChI
- InChI=1S/C27H41NO6.ClH/c1-5-28(6-2)15-23(32)34-16-22(31)27(33)12-10-20-19-8-7-17-13-18(29)9-11-25(17,3)24(19)21(30)14-26(20,27)4;/h13,19-21,24,30,33H,5-12,14-16H2,1-4H3;1H/t19-,20-,21-,24+,25-,26-,27-;/m0./s1
- IUPAC Name
- 2-[(1R,3aS,3bS,9aR,9bS,10S,11aS)-1,10-dihydroxy-9a,11a-dimethyl-7-oxo-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-oxoethyl 2-(diethylamino)acetate hydrochloride
- SMILES
- Cl.[H][C@@]12CC[C@](O)(C(=O)COC(=O)CN(CC)CC)[C@@]1(C)C[C@]([H])(O)[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C
- External Links
- PubChem Compound
- 31312
- ChemSpider
- 29051
- ChEBI
- 50854
- ChEMBL
- CHEMBL1200635
- Wikipedia
- Hydrocortamate
- Predicted Properties
Property Value Source Water Solubility 0.0855 mg/mL ALOGPS logP 2.82 ALOGPS logP 2.32 Chemaxon logS -3.8 ALOGPS pKa (Strongest Acidic) 12.61 Chemaxon pKa (Strongest Basic) 6.99 Chemaxon Physiological Charge 0 Chemaxon Hydrogen Acceptor Count 6 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 104.14 Å2 Chemaxon Rotatable Bond Count 8 Chemaxon Refractivity 129.48 m3·mol-1 Chemaxon Polarizability 52.97 Å3 Chemaxon Number of Rings 4 Chemaxon Bioavailability 1 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon